pentyl 2-[3-oxidanylidene-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]ethanoate

Systemtic Name: pentyl 2-[3-oxidanylidene-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]ethanoate Openeye Name: pentyl 2-[3-oxo-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[1-oxo-2-(4-phenylphenoxy)butyl]-2-piperazinyl]acetic acid pentyl ester IUPAC Name: pentyl 2-[3-oxo-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]acetic acid amyl ester Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CC1C(=O)NCCN1C(=O)C(CC)OC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCOC(=O)CC1C(=O)NCCN1C(=O)C(CC)OC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H34N2O5/c1-3-5-9-18-33-25(30)19-23-26(31)28-16-17-29(23)27(32)24(4-2)34-22-14-12-21(13-15-22)20-10-7-6-8-11-20/h6-8,10-15,23-24H,3-5,9,16-19H2,1-2H3,(H,28,31)